4-(2-azanyl-3,4-dicyano-5-phenyl-pyrrol-1-yl)benzoic acid

Systemtic Name: 4-(2-azanyl-3,4-dicyano-5-phenyl-pyrrol-1-yl)benzoic acid Openeye Name: 4-(2-amino-3,4-dicyano-5-phenyl-pyrrol-1-yl)benzoic acid CAS Name: 4-(2-amino-3,4-dicyano-5-phenyl-1-pyrrolyl)benzoic acid IUPAC Name: 4-(2-amino-3,4-dicyano-5-phenylpyrrol-1-yl)benzoic acid Traditional Name: 4-(2-amino-3,4-dicyano-5-phenyl-pyrrol-1-yl)benzoic acid Formula: C19H12N4O2 MolecularWeight: 328.32418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(N2C3=CC=C(C=C3)C(=O)O)N)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(N2C3=CC=C(C=C3)C(=O)O)N)C#N)C#N

InChI

InChI=1S/C19H12N4O2/c20-10-15-16(11-21)18(22)23(17(15)12-4-2-1-3-5-12)14-8-6-13(7-9-14)19(24)25/h1-9H,22H2,(H,24,25)